MUG '01 -- 15th Daylight User Group Meeting -- 6 - 9 Mar 2001

MolMind

Michael Almstetter
Morphochem AG

ABSTRACT

MolMind combines chemical synthesis planning with the design of molecules - assisting chemists in drug discovery. Using evolutionary algorithms, new molecules are breaded according to a predefined list of useful properties like similarity, physical properties or binding affinity to a protein.


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